Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | PLK1 | P53350 | 4/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.38 |
| ▸ | PPARA | Q07869 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | PLK3 | Q9H4B4 | 3/20 | 0.38 |
| ▸ | AGTR1 | P30556 | 3/20 | 0.38 |
| ▸ | AGTR2 | P50052 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CASP3 | P42574 | 1/20 | 0.38 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL135492 | 0.80 | GABRP (0.50) | ALDH1A1L3MBTL1SMN1; SMN2TDP1PLK1 | |
| SCHEMBL4998460 | 0.80 | GABRP (0.50) | ALDH1A1L3MBTL1SMN1; SMN2TDP1PLK1 | |
| SCHEMBL4625244 | 0.80 | GABRP (0.50) | ALDH1A1L3MBTL1SMN1; SMN2TDP1PLK1 | |
| SCHEMBL29398777 | 0.80 | GABRP (0.50) | ALDH1A1L3MBTL1SMN1; SMN2TDP1PLK1 | |
| SCHEMBL5002408 | 0.80 | GABRP (0.50) | ALDH1A1L3MBTL1SMN1; SMN2TDP1PLK1 | |
| SCHEMBL5709741 | 0.80 | GABRP (0.50) | ALDH1A1L3MBTL1SMN1; SMN2TDP1PLK1 | |
| SCHEMBL9500202 | 0.80 | GABRP (0.50) | ALDH1A1L3MBTL1SMN1; SMN2TDP1PLK1 | |
| SCHEMBL5002869 | 0.80 | GABRP (0.50) | ALDH1A1L3MBTL1SMN1; SMN2TDP1PLK1 | |
| SCHEMBL7386044 | 0.79 | GABRP (0.51) | ALDH1A1L3MBTL1SMN1; SMN2RAB9ATDP1 | |
| SCHEMBL23534047 | 0.76 | LMNA (0.52) | ALDH1A1L3MBTL1SMN1; SMN2RAB9ATDP1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5006532-A | Enzyme inhibitor; antiinflammatory agents | MERCK & CO. INC., INC. (US) | 1991-04-09 | — | — | US | disclosed |
| US-4904672-A | Derivatives of 3-hydroxyazabenzo[b]thiophene useful as 5-lipoxygenase inhibitors | MERCK & CO., INC. (US) | 1990-02-27 | — | — | US | disclosed |
| US-4767766-A | Derivatives of 3-hydroxyazabenzo(B)thiophene useful as 5-lipoxygenase inhibitors | MERCK & CO., INC. (US) | 1988-08-30 | — | — | US | disclosed |